Publications

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Results: 1998

Aditesh Mondal, Kevin Breitwieser, Sergi Danés, Annette Grünwald, Frank W. Heinemann, Bernd Morgenstern, Frank Müller, Michael Haumann, Maximilian Schütze, Dustin Kass, Kallol Ray, Dominik Munz
π‐Lewis Base Activation of Carbonyls and Hexafluorobenzene
Angew Chem Int Ed, 2025, 64, e202418738
DOI: 10.1002/anie.202418738
OpenAccess: Link
Keywords: High-valent metal complexes

Jiacheng Li, Cristina Duran, Balázs Pogrányi, Katy A.S. Cornish, Jared Cartwright, Sílvia Osuna, William P. Unsworth, Gideon Grogan
Divergent Oxidation Reactions ofE ‐ andZ ‐Allylic Primary Alcohols by an Unspecific Peroxygenase
Angew Chem Int Ed, 2025, 64, e202422241
DOI: 10.1002/anie.202422241
OpenAccess: Link
Keywords: Biocatalysis, Enzyme design

Anthony J. Huls, Jordi Soler, Yuxuan Su, Yunfang Yang, Marc Garcia-Borràs, Xiongyi Huang
Biocatalytic Olefin Difunctionalization for Synthesis of Chiral 2‐Azidoamines Using Nonheme Iron Enzymes
Angew Chem Int Ed, 2025, 64, e202423403
DOI: 10.1002/anie.202423403
OpenAccess: –
Keywords: Biocatalysis, Computational chemistry, Enzyme design

Najoua Choukairi Afailal, Siu-Chung Chan, Miquel Costas
Manganese‐Catalyzed Enantioselective Dearomative Epoxidation of Naphthalenes with Aqueous Hydrogen Peroxide
Angew Chem Int Ed, 2025, 64, e202504356
DOI: 10.1002/anie.202504356
OpenAccess: Link
Keywords: Aromaticity, High-valent metal complexes, Homogeneous catalysis, Oxidation, Sustainable Catalysis

Miquel Costas, Andrea Palone, Arnau Call, Aleria Garcia-Roca, Josep M. Luis, Matthew S. Sigman, Massimo Bietti, Cristina Nevado
Shaping of a Reactive Manganese Catalyst Enables Access to Polyfunctionalized Cyclohexanes via Enantioselective C(sp3)−H Bond Oxidation of 1,3‐meso Diethers
Angew Chem Int Ed, 2025, 64, e202507755
DOI: 10.1002/anie.202507755
OpenAccess: Link
Keywords: Homogeneous catalysis, Ligand design, Predictive Chemistry, Reaction mechanisms, Sustainable Catalysis

Caroline Hiefinger, Michela Marcon, Verena Pape, Guillem Casadevall, Ranit Lahmy, Christoph Haag, Julian Nazet, Michael Bartl, Astrid Bruckmann, Sílvia Osuna, Burkhard König, Andrea Hupfeld
Expanding the Repertoire of Photoswitchable Unnatural Amino Acids for Enzyme Engineering
Angew Chem Int Ed, 2025, 64, e202508562
DOI: 10.1002/anie.202508562
OpenAccess: Link
Keywords: Enzyme design

Miquel Solà
Aromaticidad molecular
AnQuimRSEQ, 2025, 121, 277-
DOI: 10.62534/rseq.aq.2086
OpenAccess: Link
Keywords: Aromaticity, Chemical bonding

Roger Monreal-Corona, Lole Jurado, Hiroya Ishikawa, Martí Gimferrer, Albert Poater, Luis F. Bobadilla, M. Rosa Axet, Sergio Posada-Pérez
Computational and experimental insights into single-atom catalysts supported on g-C3N4: Unraveling the superior stability and catalytic activity of Rh in hydroformylation reactions
Applied Surface Science, 2025, 698, 163050-
DOI: 10.1016/j.apsusc.2025.163050
OpenAccess: Link
Keywords: Computational chemistry, Joint Exp-Comp, Nanomaterials, Predictive Chemistry, Reaction mechanisms

Nicolas Joly, Clara Mauclaire, Sylvain Gaillard, Albert Poater, Jean-Luc Renaud
Dehydrogenative Coupling Reaction for the Synthesis of 5‐ and 6‐Heterocyclic Derivatives Catalyzed by Earth‐Abundant Metal‐Based Complexes
Asian J Org Chem, 2025, 14, e202400728
DOI: 10.1002/ajoc.202400728
OpenAccess: –
Keywords: Homogeneous catalysis, Joint Exp-Comp, Sustainable Catalysis

Michele Tomasini, Michal Szostak, Albert Poater
Machine Learning in Predicting Activation Barrier Energy of C=N Bond Rotation in Amides
Asian J Org Chem, 2025, 14, e202400749
DOI: 10.1002/ajoc.202400749
OpenAccess: Link
Keywords: Computational chemistry, Machine learning, Organometallics, Predictive Chemistry, Reaction mechanisms